Takeji Takui

21PUBLICATIONS
42CO-AUTHORS
Transition metal chemistryThermodynamics and statistical physicsTheoretical quantum chemistryOrganometallic chemistryChemical and thermal processes in energy and combustion
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Publications (21)

|May 22, 2023
A Kinetically Stabilized Nitrogen-Doped Triangulene Cation: Stable and NIR Fluorescent Diradical Cation with Triplet Ground State.

Shinobu Arikawa, Akihiro Shimizu, Daisuke Shiomi

|Jan 25, 2023
Adiabatic state preparation of correlated wave functions with nonlinear scheduling functions and broken-symmetry wave functions.

Kenji Sugisaki, Kazuo Toyota, Kazunobu Sato

|Nov 29, 2022
Quantum Algorithm for Numerical Energy Gradient Calculations at the Full Configuration Interaction Level of Theory.

Kenji Sugisaki, Hiroyuki Wakimoto, Kazuo Toyota

|Jun 21, 2022
Double-σ-Bonded Close-Shell Dimers and Peroxy-Linked Open-Shell Dimer Derived from a C3 Symmetric Trioxophenalenyl Neutral Diradical.

Tsuyoshi Murata, Kenta Yoshida, Shuichi Suzuki

|May 11, 2022
Synthesis and Isolation of a Kekulé Hydrocarbon with a Triplet Ground State.

Akihiro Shimizu, Tetsuya Morikoshi, Kenji Sugisaki

|Feb 21, 2022
Bis-periazulene (Cyclohepta[def]fluorene) as a Nonalternant Isomer of Pyrene: Synthesis and Characterization of Its Triaryl Derivatives.

Koki Horii, Ryohei Kishi, Masayoshi Nakano

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Frequent Collaborators

20 joint publications

Kazunobu Sato

13 joint publications

Kenji Sugisaki

10 joint publications

Daisuke Shiomi

3 joint publications

Tsuyoshi Murata